SCHEMBL2579875

SCHEMBL2579875

C=C(C)C(=O)OOC(C)OC(=O)OC(=O)OC(C)(C)C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL1792808 0.92 TSHR (0.34) TSHR
SCHEMBL3383731 0.85 TSHR (0.32) TSHR
SCHEMBL3383725 0.82 TSHR (0.41) TSHR
SCHEMBL3381260 0.78 TSHR (0.34) TSHR
SCHEMBL3381267 0.77 TSHR (0.33) TSHR
SCHEMBL10715364 0.75 TSHR (0.33) TSHR
SCHEMBL2216097 0.74 ALDH1A1 (0.42) TSHR
SCHEMBL3382085 0.74 TSHR (0.37) TSHR
SCHEMBL3382589 0.71 TSHR (0.32) TSHR
SCHEMBL3385470 0.71 CYP2D6 (0.35)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1710482-B1 LAMINATED TUBE UBE INDUSTRIES (JP) 2013-04-17 EP disclosed
US-8067075-B2 Multilayer tube UBE INDUSTRIES, INC. (JP) 2011-11-29 US disclosed
US-20070148389-A1 Multilayer tube Ube Industries, Ltd. a corporation of Japan, 1978-96 (JP) 2007-06-28 US disclosed
EP-1710482-A1 LAMINATED TUBE Ube Industries, Ltd. (JP) 2006-10-11 EP disclosed